Information card for entry 7023284

Structure parameters

• Formula: C14 H26 Al Cl2 N3
• Calculated formula: C14 H26 Al Cl2 N3
• SMILES: [Al]12(Cl)(Cl)[NH](C(C)(C)C)Cc3ccc(C[NH]2C(C)(C)C)n13
• Title of publication: Aluminum complexes incorporating symmetrical and asymmetrical tridentate pincer type pyrrolyl ligands: synthesis, characterization and reactivity study.
• Authors of publication: Liu, Pei-Hsin; Chuang, Fu-Jung; Tu, Cheng-Yi; Hu, Ching-Han; Lin, Tzu-Wei; Wang, Yu-Tang; Lin, Chia-Her; Datta, Amitabha; Huang, Jui-Hsien
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 37
• Pages of publication: 13754 - 13764
• a: 13.7242 ± 0.0004 Å
• b: 14.892 ± 0.0004 Å
• c: 17.5053 ± 0.0005 Å
• α: 90°
• β: 100.697 ± 0.001°
• γ: 90°
• Cell volume: 3515.57 ± 0.17 ų
• Cell temperature: 149 ± 2 K
• Ambient diffraction temperature: 149 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.0674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No